2-(butylamino)-4-[(4-butylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(butylamino)-4-[(4-butylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-(butylamino)-4-(4-butylanilino)-4-oxo-butanoic acid CAS Name: 2-(butylamino)-4-(4-butylanilino)-4-oxobutanoic acid IUPAC Name: 2-(butylamino)-4-(4-butylanilino)-4-oxobutanoic acid Traditional Name: 2-(butylamino)-4-(4-butylanilino)-4-keto-butyric acid Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCC

InChI

InChI=1S/C18H28N2O3/c1-3-5-7-14-8-10-15(11-9-14)20-17(21)13-16(18(22)23)19-12-6-4-2/h8-11,16,19H,3-7,12-13H2,1-2H3,(H,20,21)(H,22,23)